## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
E |
187 |
51 |
14815 |
◊ |
C |
x,y,z |
1_555 |
192 |
50 |
14234 |
1892.7 |
-22.1 |
0.028 |
21 |
7 |
0 |
0.455 |
2 |
|
D |
187 |
48 |
14590 |
◊ |
A |
x,y,z |
1_555 |
184 |
49 |
14236 |
1883.4 |
-24.2 |
0.010 |
17 |
8 |
0 |
0.455 |
3 |
|
F |
106 |
33 |
13865 |
◊ |
B |
x,y,z |
1_555 |
109 |
31 |
12829 |
1118.8 |
-12.5 |
0.075 |
16 |
6 |
0 |
0.455 |
Average: |
1631.6 |
-19.6 |
0.038 |
18 |
7 |
0 |
0.455 |
2 |
4 |
|
[FAD]B:300 |
53 |
1 |
972 |
f |
B |
x,y,z |
1_555 |
99 |
32 |
12829 |
697.8 |
-11.6 |
0.386 |
16 |
0 |
0 |
0.564 |
5 |
|
[FAD]D:300 |
52 |
1 |
972 |
f |
D |
x,y,z |
1_555 |
94 |
33 |
14590 |
676.4 |
-12.3 |
0.365 |
13 |
0 |
0 |
0.564 |
6 |
|
[FAD]C:300 |
52 |
1 |
978 |
f |
C |
x,y,z |
1_555 |
97 |
34 |
14234 |
675.2 |
-10.5 |
0.449 |
15 |
0 |
0 |
0.564 |
7 |
|
[FAD]F:300 |
53 |
1 |
975 |
f |
F |
x,y,z |
1_555 |
97 |
34 |
13865 |
664.9 |
-11.2 |
0.424 |
17 |
0 |
0 |
0.564 |
8 |
|
[FAD]E:300 |
53 |
1 |
967 |
f |
E |
x,y,z |
1_555 |
94 |
34 |
14815 |
663.9 |
-11.8 |
0.406 |
15 |
0 |
0 |
0.564 |
9 |
|
[FAD]A:300 |
52 |
1 |
970 |
f |
A |
x,y,z |
1_555 |
98 |
34 |
14236 |
662.2 |
-10.9 |
0.411 |
17 |
0 |
0 |
0.564 |
Average: |
673.4 |
-11.4 |
0.407 |
16 |
0 |
0 |
0.564 |
3 |
10 |
|
F |
63 |
19 |
13865 |
◊ |
A |
x,y,z |
1_555 |
75 |
21 |
14236 |
687.8 |
-0.3 |
0.567 |
8 |
9 |
0 |
0.000 |
11 |
|
C |
85 |
22 |
14234 |
◊ |
B |
x,y,z |
1_555 |
73 |
21 |
12829 |
680.4 |
0.4 |
0.577 |
10 |
6 |
0 |
0.000 |
12 |
|
F |
69 |
17 |
13865 |
◊ |
E |
x,y,z |
1_555 |
53 |
16 |
14815 |
559.1 |
-1.8 |
0.532 |
6 |
2 |
0 |
0.000 |
13 |
|
D |
51 |
14 |
14590 |
◊ |
B |
x,y,z |
1_555 |
64 |
15 |
12829 |
536.1 |
-0.2 |
0.629 |
7 |
7 |
0 |
0.000 |
Average: |
615.8 |
-0.5 |
0.576 |
8 |
6 |
0 |
0.000 |
4 |
14 |
|
C |
52 |
16 |
14234 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
52 |
16 |
14236 |
462.6 |
4.1 |
0.882 |
8 |
6 |
0 |
0.002 |
5 |
15 |
|
D |
52 |
16 |
14590 |
◊ |
E |
x-1,y,z |
1_455 |
45 |
12 |
14815 |
426.6 |
-1.6 |
0.452 |
3 |
4 |
0 |
0.023 |
6 |
16 |
|
B |
45 |
14 |
12829 |
◊ |
C |
-x,y-1/2,-z+1/2 |
3_545 |
39 |
14 |
14234 |
352.2 |
0.0 |
0.637 |
1 |
1 |
0 |
0.000 |
7 |
17 |
|
B |
38 |
12 |
12829 |
◊ |
F |
x-1/2,-y-1/2,-z+1 |
4_446 |
41 |
13 |
13865 |
323.5 |
3.1 |
0.857 |
6 |
2 |
0 |
0.000 |
8 |
18 |
|
C |
34 |
10 |
14234 |
◊ |
F |
-x+1/2,-y,z-1/2 |
2_554 |
24 |
7 |
13865 |
272.2 |
-0.7 |
0.516 |
2 |
2 |
0 |
0.000 |
9 |
19 |
|
F |
19 |
5 |
13865 |
◊ |
C |
x,y,z |
1_555 |
16 |
5 |
14234 |
173.7 |
-0.0 |
0.620 |
1 |
0 |
0 |
0.000 |
20 |
|
B |
2 |
1 |
12829 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
14236 |
7.7 |
0.0 |
0.601 |
0 |
0 |
0 |
0.000 |
Average: |
90.7 |
0.0 |
0.611 |
1 |
0 |
0 |
0.000 |
10 |
21 |
|
D |
17 |
5 |
14590 |
◊ |
F |
x-1,y,z |
1_455 |
20 |
7 |
13865 |
149.2 |
-1.3 |
0.250 |
1 |
0 |
0 |
0.000 |
11 |
22 |
|
A |
13 |
3 |
14236 |
◊ |
E |
x-1/2,-y+1/2,-z+1 |
4_456 |
26 |
11 |
14815 |
143.7 |
1.0 |
0.738 |
2 |
0 |
0 |
0.000 |
12 |
23 |
|
E |
17 |
8 |
14815 |
◊ |
D |
x,y,z |
1_555 |
17 |
7 |
14590 |
140.2 |
0.2 |
0.575 |
0 |
0 |
0 |
0.000 |
13 |
24 |
|
E |
12 |
4 |
14815 |
◊ |
B |
x,y,z |
1_555 |
21 |
5 |
12829 |
128.9 |
-0.3 |
0.549 |
0 |
0 |
0 |
0.000 |
25 |
|
F |
8 |
2 |
13865 |
◊ |
D |
x,y,z |
1_555 |
12 |
2 |
14590 |
70.2 |
-0.2 |
0.538 |
0 |
0 |
0 |
0.000 |
Average: |
99.5 |
-0.2 |
0.544 |
0 |
0 |
0 |
0.000 |
14 |
26 |
|
D |
16 |
6 |
14590 |
◊ |
C |
x,y,z |
1_555 |
14 |
4 |
14234 |
116.6 |
1.2 |
0.740 |
2 |
2 |
0 |
0.000 |
27 |
|
E |
16 |
6 |
14815 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
14236 |
112.2 |
1.6 |
0.769 |
2 |
1 |
0 |
0.000 |
Average: |
114.4 |
1.4 |
0.754 |
2 |
2 |
0 |
0.000 |
15 |
28 |
|
[EDO]F:303 |
4 |
1 |
184 |
f |
F |
x,y,z |
1_555 |
21 |
9 |
13865 |
107.9 |
3.4 |
0.524 |
2 |
0 |
0 |
0.000 |
16 |
29 |
|
[FMT]C:302 |
3 |
1 |
149 |
f |
C |
x,y,z |
1_555 |
17 |
8 |
14234 |
90.5 |
-0.5 |
0.352 |
1 |
0 |
0 |
0.013 |
17 |
30 |
|
[FMT]C:301 |
3 |
1 |
150 |
f |
C |
x,y,z |
1_555 |
20 |
9 |
14234 |
89.6 |
-1.0 |
0.288 |
3 |
0 |
0 |
0.032 |
18 |
31 |
|
[FMT]D:304 |
3 |
1 |
149 |
f |
D |
x,y,z |
1_555 |
22 |
9 |
14590 |
89.4 |
-1.1 |
0.283 |
3 |
0 |
0 |
0.030 |
19 |
32 |
|
[FMT]B:303 |
3 |
1 |
149 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
12829 |
85.8 |
-1.0 |
0.275 |
2 |
0 |
0 |
0.028 |
20 |
33 |
|
[EDO]A:303 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
14236 |
82.0 |
2.4 |
0.431 |
1 |
0 |
0 |
0.000 |
21 |
34 |
|
[SO4]B:301 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
12829 |
75.7 |
-8.7 |
0.922 |
1 |
0 |
0 |
0.138 |
22 |
35 |
|
[SO4]A:301 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
14236 |
67.4 |
-9.0 |
0.800 |
0 |
0 |
0 |
0.112 |
23 |
36 |
|
C |
6 |
3 |
14234 |
◊ |
[SO4]A:301 |
-x+1/2,-y,z-1/2 |
2_554 |
4 |
1 |
185 |
42.2 |
-4.9 |
0.892 |
0 |
0 |
0 |
0.032 |
24 |
37 |
|
C |
5 |
2 |
14234 |
◊ |
[EDO]A:303 |
-x+1/2,-y,z-1/2 |
2_554 |
2 |
1 |
186 |
38.1 |
1.6 |
0.937 |
1 |
0 |
0 |
0.000 |
25 |
38 |
|
D |
5 |
2 |
14590 |
◊ |
[FAD]E:300 |
x-1,y,z |
1_455 |
1 |
1 |
967 |
33.8 |
0.9 |
0.812 |
1 |
0 |
0 |
0.000 |
26 |
39 |
|
B |
4 |
2 |
12829 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
5 |
2 |
14236 |
24.8 |
-0.3 |
0.433 |
0 |
0 |
0 |
0.000 |
27 |
40 |
|
D |
5 |
3 |
14590 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
6 |
5 |
14236 |
22.2 |
0.2 |
0.681 |
0 |
0 |
0 |
0.000 |
28 |
41 |
|
[EDO]A:303 |
1 |
1 |
186 |
f |
[SO4]A:301 |
x,y,z |
1_555 |
1 |
1 |
185 |
13.0 |
-1.2 |
0.894 |
0 |
0 |
0 |
0.015 |
|